In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2010 | 17 | Yes |
Popular Name: (1S,8aR)-N-(5-methyl-2-pyridyl)-1,2,3,5,6,7,8,8a-octahydroindolizin-1-amine (1S,8aR)-N-(5-methyl-2-pyridyl)-…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.39 | 7.9 | -83.67 | 3 | 3 | 2 | 31 | 233.359 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.39 | 7.42 | -36.19 | 2 | 3 | 1 | 29 | 232.351 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.